Basic information
- Standard SMILES
C1CC[NH2+]CC1.O=C([O-])CN1C(=O)SC(=Cc2csc(NC(c3ccccc3)(c3ccccc3)c3ccccc3)n2)C1=O- InChIKey
WCVOITFIUCPYJQ-UHFFFAOYSA-N- Molecular formula
- C33H32N4O4S2
- Average molar mass
- 612.8 g/mol
Names & identifiers
- Preferred name
- Piperidinium 2,4-Dioxo-5-(2-tritylaminothiazol-4-ylmethylene)thiazolidine-3-acetate
- IUPAC
- 2-[2,4-dioxo-5-[[2-(tritylamino)-1,3-thiazol-4-yl]methylidene]-1,3-thiazolidin-3-yl]acetate;piperidin-1-ium
Names & synonyms
WCVOITFIUCPYJQ-UHFFFAOYSA-NPiperidinium 2,4-Dioxo-5-(2-tritylaminothiazol-4-ylmethylene)thiazolidine-3-acetate
Database identifiers
- PubChem CID
- 73454615
Properties
Computed structural properties
- Topological polar surface area
- 173 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 859
Related reactions
1 records
Compound notes
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